8-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonylquinoline

Systemtic Name: 8-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonylquinoline Openeye Name: 8-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonylquinoline CAS Name: 8-[[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 8-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonylquinoline Traditional Name: 8-[4-(3,4-dimethylphenyl)sulfonylpiperazino]sulfonylquinoline Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C21H23N3O4S2/c1-16-8-9-19(15-17(16)2)29(25,26)23-11-13-24(14-12-23)30(27,28)20-7-3-5-18-6-4-10-22-21(18)20/h3-10,15H,11-14H2,1-2H3